ChemSpider 2D Image | Methyl 4-{4-[(3,5-dichlorobenzoyl)amino]phenyl}-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate | C23H23Cl2N3O4

Methyl 4-{4-[(3,5-dichlorobenzoyl)amino]phenyl}-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

  • Molecular FormulaC23H23Cl2N3O4
  • Average mass476.352 Da
  • Monoisotopic mass475.106567 Da
  • ChemSpider ID22569171

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-{4-[(3,5-Dichlorobenzoyl)amino]phényl}-6-méthyl-2-oxo-1-propyl-1,2,3,4-tétrahydro-5-pyrimidinecarboxylate de méthyle [French] [ACD/IUPAC Name]
5-Pyrimidinecarboxylic acid, 4-[4-[(3,5-dichlorobenzoyl)amino]phenyl]-1,2,3,4-tetrahydro-6-methyl-2-oxo-1-propyl-, methyl ester [ACD/Index Name]
Methyl 4-{4-[(3,5-dichlorobenzoyl)amino]phenyl}-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate [ACD/IUPAC Name]
Methyl-4-{4-[(3,5-dichlorbenzoyl)amino]phenyl}-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydro-5-pyrimidincarboxylat [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 608.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.4±3.0 kJ/mol
Flash Point: 322.0±31.5 °C
Index of Refraction: 1.606
Molar Refractivity: 123.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.21
ACD/LogD (pH 5.5): 4.59
ACD/BCF (pH 5.5): 1803.94
ACD/KOC (pH 5.5): 7454.19
ACD/LogD (pH 7.4): 4.59
ACD/BCF (pH 7.4): 1803.72
ACD/KOC (pH 7.4): 7453.30
Polar Surface Area: 88 Å2
Polarizability: 49.0±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 358.0±3.0 cm3

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